Measurement and modelization of VLE of binary mixtures of propyl acetate, butyl acetate or isobutyl acetate with methanol at pressure of 0.6 Mpa

doi:10.1016/j.cjche.2015.12.017

Chinese Journal of Chemical Engineering ›› 2016, Vol. 24 ›› Issue (5): 630-637.DOI: 10.1016/j.cjche.2015.12.017

• 第25届中国过程控制会议专栏 • 上一篇下一篇

Measurement and modelization of VLE of binary mixtures of propyl acetate, butyl acetate or isobutyl acetate with methanol at pressure of 0.6 Mpa

P. Susial¹, D. García¹, R. Susial¹, Y. C. Clavijo¹, A. Martín²

1 Escuela de Ingenierias Industriales y Civiles, Universidad de Las Palmas de Gran Canaria, 35017 Las Palmas de Gran Canaria, Canary Islands, Spain;
2 Dept. Ingeniería Química y Tecnología del Medio Ambiente, Universidad de Valladolid, 47071 Valladolid, Spain

收稿日期:2015-04-15 修回日期:2015-11-16 出版日期:2016-05-28 发布日期:2016-06-14
通讯作者: P. Susial, A. Martín

Measurement and modelization of VLE of binary mixtures of propyl acetate, butyl acetate or isobutyl acetate with methanol at pressure of 0.6 Mpa

P. Susial¹, D. García¹, R. Susial¹, Y. C. Clavijo¹, A. Martín²

1 Escuela de Ingenierias Industriales y Civiles, Universidad de Las Palmas de Gran Canaria, 35017 Las Palmas de Gran Canaria, Canary Islands, Spain;
2 Dept. Ingeniería Química y Tecnología del Medio Ambiente, Universidad de Valladolid, 47071 Valladolid, Spain

Received:2015-04-15 Revised:2015-11-16 Online:2016-05-28 Published:2016-06-14
Contact: P. Susial, A. Martín

摘要/Abstract

摘要： The vapor-liquid equilibriumof binarymixtures of propyl acetate, butyl acetate and isobutyl acetate withmethanol has been determined at a constant pressure of 0.6 MPa. Results have been modeledwith the Peng-Robinson equation, a traditional cubic equation of state widely employed in chemical industries, as well as with the perturbed-chain statistical associating fluid PC-SAFT theory of Gross-Sadowski. By correlation of the binary interaction parameters of these equations, the measured vapor-liquid equilibrium data can be accurately predicted. Thus, thiswork shows that thesemodels are able to represent the experimental data for systemswith associating compounds via hydrogen bonding.

关键词: VLE isobaric data, Propyl acetate, Butyl acetate, Isobutyl acetate, Methanol, EOS

Abstract: The vapor-liquid equilibriumof binarymixtures of propyl acetate, butyl acetate and isobutyl acetate withmethanol has been determined at a constant pressure of 0.6 MPa. Results have been modeledwith the Peng-Robinson equation, a traditional cubic equation of state widely employed in chemical industries, as well as with the perturbed-chain statistical associating fluid PC-SAFT theory of Gross-Sadowski. By correlation of the binary interaction parameters of these equations, the measured vapor-liquid equilibrium data can be accurately predicted. Thus, thiswork shows that thesemodels are able to represent the experimental data for systemswith associating compounds via hydrogen bonding.

Key words: VLE isobaric data, Propyl acetate, Butyl acetate, Isobutyl acetate, Methanol, EOS

P. Susial, D. García, R. Susial, Y. C. Clavijo, A. Martín. Measurement and modelization of VLE of binary mixtures of propyl acetate, butyl acetate or isobutyl acetate with methanol at pressure of 0.6 Mpa[J]. Chinese Journal of Chemical Engineering, 2016, 24(5): 630-637.

参考文献

[1] A. Breitholz, J.S. Lim, J.W. Kang, K.P. Yoo, Nonrandom lattice fluid group contribution parameter for vapor-liquid equilibriumof esters and theirmixtures, Korean J. Chem. Eng. 26(2009) 230-234.

[2] A. Aucejo, S. Loras, R. Muñoz, J. Wisniak, H. Segura, Phase equilibria and multiple azeotropy in the associating system methanol + diethylamine, J. Chem. Eng. Data 42(1997) 1201-1207.

[3] A.M. Blanco, J. Ortega, Densities and vapor-liquid equilibriumvalues for binary mixtures composed ofmethanol+an ethyl ester at 141.3 kPa with application of an extended correlation equation for isobaric VLE data, J. Chem. Eng. Data 43(1998) 638-645.

[4] A.F. Cristino, S. Rosa, P.Morgado, A. Galindo, E.J.M. Filipe, A.M.F. Palvra, C.A. Nieto de Castro, High-temperature vapour-liquid equilibrium for the (water + alcohol) systems and modelling with SAFT-VR:2. water +1-propanol, J. Chem. Termodynamics 60(2013) 15-18.

[5] P. Susial, A. Sosa-Rosario, J.J. Rodriguez-Henriquez, R. Rios-Santana, Vapor pressures and VLE data measurements. Ethyl acetate + ethanol at 0.1, 0.5 and 0.7 MPa binary system, J. Chem. Eng. Jpn. 44(2011) 155-163.

[6] P. Susial, D. García-Vera, R. Susial, V.D. Castillo, E.J. Estupiñan, J.C. Apolinario, J.J. Rodriguez-Henriquez, Experimental determination of vapor-liquid equilibria. Binary systems of methyl acetate, ethyl acetate and propyl acetate with 1-propanol at 0.6 MPa, J. Chem. Eng. Data 58(2013) 2861-2867.

[7] A.M. Blanco, Analysis of the vapor-liquid equilibrium at 141.3 kPa of binary mixtures containing methanol with n-alkanes (C5, C6) and alkyl esters(Doctoral thesis) University of La Laguna, Canary Islands, 1997.

[8] P. Susial, J.J. Rodríguez-Henríquez, J.C. Apolinario, V.D. Castillo, E.J. Estupiñan, Vapor pressures and vapor-liquid equilibrium of propyl acetate + methanol or +1-propanol at 0.15 MPa. Binary systems, Rev. Mex. Ing. Quim. 12(12) (2013) 595-608.

[9] J. Gmehling, U. Onken, Vapor-liquid equilibrium data collection, vol. 1, Dechema, Frankfurt, 2005(Part g).

[10] J. Gmehling, U. Onken, W. Arlt, Vapor-liquid equilibrium data collection, vol. 1, Dechema, Frankfurt, 1982(Part 2c).

[11] J. Gmehling, U. Onken, J.R. Rarey-Nies, Vapor-liquid equilibrium data collection, vol. 1, Dechema, Frankfurt, 1988(Part 2e).

[12] J.M. Resa, C. González, B. Moradillo, J. Lanz, (Vapour-liquid) equilibria for (methanol + butyl acetate), (vinyl acetate + butyl acetate), (methanol + isobutyl acetate), and (vinyl acetate + isobutyl acetate), J. Chem. Thermodynamics 30(1998) 1207-1219.

[13] F. Espiau, J. Ortega, E. Penco, J. Wisniak, Advances in the correlation of thermodynamic properties of binary systems applied to methanol mixtures with butyl esters, Ind. Eng. Chem. Res. 49(2010) 9548-9558.

[14] P. Susial, J.C. Apolinario, V.D. Castillo, E.J. Estupiñan, J.J. Rodríguez-Henríquez, Isobaric VLE for the binary systems isobutyl acetate + methanol or +1-propanol at 0.15 MPa, Afinidad 69(69) (2012) 95-100.

[15] D.Y. Peng, D.B. Robinson, A new two-constant equation of state, Ind. Eng. Chem. Fundam. 15(1976) 59-64.

[16] D.S.H. Wong, S.I. Sandler, A theoretically correct mixing rule for cubic equations of state, AIChE J. 38(1992) 671-680.

[17] W.G. Chapman, G. Jackson, K.E. Gubbins, Phase equilibria of associating fluids. Chain molecules with multiple bonding sites, Mol. Phys. 65(1988) 1057-1079.

[18] W.G. Chapman, K.E. Gubbins, G. Jackson,M. Radosz, SAFT:Equation-of-state solution model for associating fluids, Fluid Phase Equilib. 52(1989) 31-38.

[19] J.A. Baker, D. Henderson, Perturbation theory and equation of state for fluids:The square-well potential, J. Chem. Phys. 47(1967) 2856-2861.

[20] J.A. Baker, D. Henderson, Perturbation theory and equation of state for fluids:II. A successful theory of liquids, J. Chem. Phys. 47(1967) 4714-4720.

[21] J. Gross, G. Sadowski, Perturbed-chain, SAFT an equation of state based on a perturbation theory for chain molecules, Ind. Eng. Chem. Res. 40(2001) 1244-1260.

[22] J. Gross, G. Sadowski, Application of the perturbed-chain SAFT equation of state to associating systems, Ind. Eng. Chem. Res. 41(2002) 5510-5515.

[23] TRC thermodynamic tables non-hydrocarbons and hydrocarbons, Thermodynamic Research Center, Texas A and M University System, College Station, Tx, 1993.

[24] J. Acosta, A. Arce, E. Rodil, A. Soto, A thermodynamic study on binary and ternary mixtures of acetonitrile, water and butyl acetate, Fluid Phase Equilib. 203(2002) 83-98.

[25] A. Martín, M.D. Bermejo, F.A. Mato, M.J. Cocero, Teaching advanced equations of state in applied thermodynamics courses using open source programs, Educ. Chem. Eng. 6(2011) e114-e121.

[26] H. Renon, J.M. Prausnitz, Local compositions in thermodynamic excess functions for liquid mixtures, AIChE J. 14(1968) 135-144.

[27] M.S.Wertheim, Fluids with highly directional attractive forces. I. Statistical thermodynamics, J. Stat. Phys. 35(1984) 19-34; II. Thermodynamic perturbation theory and integral equations, J. Stat. Phys. 35(1984) 35-47; III. Multiple attraction sites, J. Stat. Phys. 42(1986) 459-476; IV. Equilibrium polymerization, J. Stat. Phys. 42(1986) 477-492.

[28] J.P. Wolbach, S.I. Sandler, Using molecular orbital calculations to describe the phase behavior of cross-associating mixtures, Ind. Eng. Chem. Res. 37(1998) 2917-2928.

[29] P. Susial, J.J. Rodríguez-Henríquez, J.C. Apolinario, V.D. Castillo, E.J. Estupiñan, Vapour pressures and vapour-liquid equilibria of binary systems of n-propyl acetate and isobutyl acetate with ethanol or 2-propanol at 0.15 MPa, J. Serb. Chem. Soc. 77(2012) 1243-1257.

[30] M. Kleiner, G. Sadowski, Modeling of polar systems using PCP-SAFT:An approach to account for induced-association interactions, J. Phys. Chem. C 111(2007) 15544-15553.

[31] A. Tihic, G.M. Kontogeorgis, N. von Solms, M.L. Michelsen, A predictive groupcontribution simplified PC-SAFT equation of state:Application to polymer systems, Ind. Eng. Chem. Res. 47(2008) 5092-5101.

Measurement and modelization of VLE of binary mixtures of propyl acetate, butyl acetate or isobutyl acetate with methanol at pressure of 0.6 Mpa

Measurement and modelization of VLE of binary mixtures of propyl acetate, butyl acetate or isobutyl acetate with methanol at pressure of 0.6 Mpa

PDF (PC)

可视化

摘要/Abstract

引用本文

使用本文

参考文献

相关文章 15

编辑推荐

Metrics

本文评价

[1]	Tingjun Fu, Ran Wang, Kun Ren, Liangliang Zhang, Zhong Li. Intensified shape selectivity and alkylation reaction for the two-step conversion of methanol aromatization to p-xylene[J]. 中国化学工程学报, 2023, 59(7): 240-250.
[2]	Pengcheng Zou, Kai Wang. Methanolysis of amides under high-temperature and high-pressure conditions with a continuous tubular reactor[J]. 中国化学工程学报, 2023, 58(6): 170-178.
[3]	Wenying Zhao, Yuxiang Ge, Xuxue Zhang, Xiaoyan Sun, Shuguang Xiang. A generalized alpha function of Peng-Robison equation of state for non-polar, weakly polar and polar compounds[J]. 中国化学工程学报, 2023, 58(6): 234-243.
[4]	Jiaxin Wu, Chenxiao Wang, Xianliang Meng, Haichen Liu, Ruizhi Chu, Guoguang Wu, Weisong Li, Xiaofeng Jiang, Deguang Yang. Enhancement of catalytic and anti-carbon deposition performance of SAPO-34/ZSM-5/quartz films in MTA reaction by Si/Al ratio regulation[J]. 中国化学工程学报, 2023, 56(4): 314-324.
[5]	Xing Su, Ning Qiao, Bao-Chang Sun. A route for the study on mass transfer enhancement by adding particles in liquid phase[J]. 中国化学工程学报, 2022, 48(8): 158-165.
[6]	Siyue Ren, Xiao Feng. Emergy evaluation of aromatics production from methanol and naphtha[J]. 中国化学工程学报, 2022, 46(6): 134-141.
[7]	Xiangjun Li, Shujun Li, Xiaoping Wang, Muhammad Asif Nawaz, Dianhua Liu. Polyoxymethylene dimethyl ethers synthesis from methanol and formaldehyde solution over one-pot synthesized spherical mesoporous sulfated zirconia[J]. 中国化学工程学报, 2022, 46(6): 161-172.
[8]	Youwei Yang, Jingyu Zhang, Yueqi Gao, Busha Assaba Fayisa, Antai Li, Shouying Huang, Jing Lv, Yue Wang, Xinbin Ma. Highly dispersed nickel boosts catalysis by Cu/SiO₂ in the hydrogenation of CO₂-derived ethylene carbonate to methanol and ethylene glycol[J]. 中国化学工程学报, 2022, 43(3): 77-85.
[9]	Busha Assaba Fayisa, Yushan Xi, Youwei Yang, Yueqi Gao, Antai Li, Mei-Yan Wang, Jing Lv, Shouying Huang, Yue Wang, Xinbin Ma. Pt-modulated Cu/SiO₂ catalysts for efficient hydrogenation of CO₂-derived ethylene carbonate to methanol and ethylene glycol[J]. 中国化学工程学报, 2022, 41(1): 366-373.
[10]	Junhua Gao, Keming Ji, Hao Zhou, Jiayao Xun, Zenghou Liu, Kan Zhang, Ping Liu. Synthesis and characterization of BZSM-5 and its catalytic performance in the methanol to hydrocarbons reaction[J]. 中国化学工程学报, 2021, 35(7): 196-203.
[11]	Huaiqing An, Hua Li, Jibin Zhou, Jinling Zhang, Tao Zhang, Mao Ye, Zhongmin Liu. Kinetics of steam regeneration of SAPO-34 zeolite catalyst in methanol-to-olefins (MTO) process[J]. 中国化学工程学报, 2021, 35(7): 231-238.
[12]	Zhiquan Wang, Liang Wang, Zhihong Yuan, Bingzhen Chen. Data-driven optimal operation of the industrial methanol to olefin process based on relevance vector machine[J]. 中国化学工程学报, 2021, 34(6): 106-115.
[13]	Muralikrishna Boni, S. Srinivasa Rao, G. Naga Srinivasulu. Performance evaluation of the incorporation of different wire meshes in between perforated current collectors and membrane electrode assembly on the Passive Direct methanol fuel cell[J]. 中国化学工程学报, 2021, 32(4): 360-367.
[14]	Han Zu, Hui Zhang, Anwen Fan, Jie Gu, Yao Nie, Pengjie Luo, Yan Xu. Highly efficient synthesis of (R)-1,3-butanediol via anti-Prelog reduction of 4-hydroxy-2-butanone with absolute stereoselectivity by a newly isolated Pichia kudriavzevii[J]. 中国化学工程学报, 2020, 28(8): 2160-2166.
[15]	Lingtao Kong, Shengtao Xu, Xue Liu, Chaofan Liu, Dandan Zhang, Ling Zhao. Effects of iron precursors on the structure and catalytic performance of iron molybdate prepared by mechanochemical route for methanol to formaldehyde[J]. 中国化学工程学报, 2020, 28(6): 1603-1611.